1-methylnaphthalen-2-ol

• ChemBase ID: 307688
• Molecular Formular: C11H10O
• Molecular Mass: 158.1965
• Monoisotopic Mass: 158.07316494
• SMILES: c1(c2c(ccc1O)cccc2)C
• Canonical SMILES: Oc1ccc2c(c1C)cccc2
• InChI: InChI=1S/C11H10O/c1-8-10-5-3-2-4-9(10)6-7-11(8)12/h2-7,12H,1H3
• InChIKey: BBOCZFGVXFNCTC-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 1-methylnaphthalen-2-ol
• IUPAC Traditional name: 1-methylnaphthalen-2-ol
• Synonyms: 1-methyl-2-naphthol

Database IDs

• CAS Number: 1076-26-2
• MDL Number: MFCD00029266

CALCULATED PROPERTIES

• H Acceptors: 1
• H Donor: 1
• LogD (pH = 5.5): 3.1725695
• LogD (pH = 7.4): 3.171849
• Log P: 3.1725786
• Molar Refractivity: 49.5303 cm^3
• Polarizability: 20.307535 Å^3
• Polar Surface Area: 20.23 Å^2